3,4,5,6-tetrahydro-2H-quinolin-1-amine

C9H14N2 — CID 88988157

IUPAC3,4,5,6-tetrahydro-2H-quinolin-1-amine
SMILESNN1CCCC2=C1C=CCC2
InChIInChI=1S/C9H14N2/c10-11-7-3-5-8-4-1-2-6-9(8)11/h2,6H,1,3-5,7,10H2
InChIKeyKJRYRTDPFBWGFP-UHFFFAOYSA-N
MW150.23 g/mol
LogP1.56
Rot. Bonds

About 3,4,5,6-tetrahydro-2H-quinolin-1-amine

3,4,5,6-tetrahydro-2H-quinolin-1-amine (PubChem CID 88988157) has the molecular formula C9H14N2 and a molecular weight of 150.23 g/mol. Its IUPAC name is 3,4,5,6-tetrahydro-2H-quinolin-1-amine.

Molecular Properties

Compound Name3,4,5,6-tetrahydro-2H-quinolin-1-amine
PubChem CID88988157
Molecular FormulaC9H14N2
Molecular Weight150.23 g/mol
Exact Mass150.12
IUPAC Name3,4,5,6-tetrahydro-2H-quinolin-1-amine
SMILESNN1CCCC2=C1C=CCC2
InChIInChI=1S/C9H14N2/c10-11-7-3-5-8-4-1-2-6-9(8)11/h2,6H,1,3-5,7,10H2
InChIKeyKJRYRTDPFBWGFP-UHFFFAOYSA-N
XLogP1.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.23
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

6-Fluoro-2,3,4,5-tetrahydroindol-1-amine
CID 89009830
5,6,7,8-tetrahydro-1H-isoquinolin-2-amine
CID 18428594
8-Methyl-7-azabicyclo[4.2.0]octa-1(6),4-dien-7-amine
CID 68248361
2,3,4,10a-tetrahydro-1H-acridin-10-amine
CID 87629165
1-iodo-3,4,5,6-tetrahydro-2H-quinoline
CID 118190427
1-methyl-3,4,5,6-tetrahydro-2H-quinoline
CID 130182705
5,6,7,8-tetrahydro-2H-quinolin-1-amine
CID 139834031
2,5,6,7-Tetrahydrocyclopenta[b]pyridin-1-amine
CID 141130699
3,4,6,7-tetrahydro-1H-isoquinolin-2-amine
CID 142115083
5-[(1Z)-buta-1,3-dienyl]-6-methyl-3,4-dihydro-2H-pyridin-1-amine;ethane
CID 145152600
5-[(1Z)-buta-1,3-dienyl]-6-methyl-3,4-dihydro-2H-pyridin-1-amine
CID 145152601
ethane;6-methyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyridin-1-amine
CID 145152677

Frequently Asked Questions

What is the IUPAC name of 3,4,5,6-tetrahydro-2H-quinolin-1-amine?
The IUPAC name of 3,4,5,6-tetrahydro-2H-quinolin-1-amine (CID 88988157) is 3,4,5,6-tetrahydro-2H-quinolin-1-amine.
What is the SMILES notation for 3,4,5,6-tetrahydro-2H-quinolin-1-amine?
The canonical SMILES for 3,4,5,6-tetrahydro-2H-quinolin-1-amine is NN1CCCC2=C1C=CCC2.
What is the InChIKey of 3,4,5,6-tetrahydro-2H-quinolin-1-amine?
The InChIKey is KJRYRTDPFBWGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c10-11-7-3-5-8-4-1-2-6-9(8)11/h2,6H,1,3-5,7,10H2.
What are the key properties of 3,4,5,6-tetrahydro-2H-quinolin-1-amine?
3,4,5,6-tetrahydro-2H-quinolin-1-amine has a molecular weight of 150.23 g/mol, XLogP of 1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,6-tetrahydro-2H-quinolin-1-amine is sourced from PubChem (CID 88988157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).